Base information
| Cat. No. | |
| CAS No. | 400-76-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H6F3NO2 |
| Molecular Weight | 205.134 |
| Exact Mass | 205.035 |
| XLogP3 | 2.567 |
| Mr | 42.8077 |
| PSA | 63.32 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1ccc(c(c1)C(F)(F)F)N |
